| CAS Number | 1365836-85-6 |
| Catalog Number | AG01EK5Q |
| Chemical Name | 3-(1H-imidazol-1-yl)-2-methylpropanoic acid hydrochloride |
| IUPAC Name | 3-imidazol-1-yl-2-methylpropanoic acid;hydrochloride |
| InChI | InChI=1S/C7H10N2O2.ClH/c1-6(7(10)11)4-9-3-2-8-5-9;/h2-3,5-6H,4H2,1H3,(H,10,11);1H |
| InChI Key | GQAPFBYSZAHSJD-UHFFFAOYSA-N |
| MDL Number | MFCD25371524 |
| Molecular Formula | C7H11ClN2O2 |
| Molecular Weight | 190.6274 |
| SMILES | Cl.CC(C(O)=O)CN1C=NC=C1 |
| Synonyms | 1365836-85-6,
3-(1H-Imidazol-1-yl)-2-methylpropanoic acid hydrochloride,
CHEMCOLLECT KT001661,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.627g/mol |
| Monoisotopic Mass | 190.051g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
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